Vitas-M small molecule compound
(5E)-5-(4-hydroxy-3-nitrobenzylidene)-1,3-dimethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL416086
SMILES S=C1N(C)C(=O)/C(=C\c2ccc(c(c2)[N+](=O)[O-])O)/N1C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H11N3O4S MW 293.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O4S/c1-13-9(11(17)14(2)12(13)20)6-7-3-4-10(16)8(5-7)15(18)19/h3-6,16H,1-2H3/b9-6+InChIKey
IKYDEVXECLBIJQ-RMKNXTFCSA-NSynonyms
(5E)5((4HYDROXY3NITROPHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5E)5(4hydroxy3nitrobenzylidene)13dimethyl2thioxoimidazolidin4one
CN1C(=CC2=CC(=C(C=C2)O)(N+)(=O)(O))C(=O)N(C1=S)C
InChI=1SC12H11N3O4Sc1139(11(17)14(2)12(13)20)673410(16)8(57)15(18)19h3616H12H3b96+
MFCD30706947
S=C1N(C)C(=O)C(=Cc2ccc(c(c2)(N+)(=O)(O))O)N1C
ZINC000000473866
ZINC473866
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